2-Amino-1,2,3,4-tetrahydronaphthalene-1,6,7-triol
Basic information
- CAS
46269-17-4- Standard SMILES
NC1CCc2cc(O)c(O)cc2C1O- InChIKey
DTKDYAXITHKMGK-UHFFFAOYSA-N- Molecular formula
- C10H13NO3
- Average molar mass
- 195.21 g/mol
- Monoisotopic mass
- 195.08954328
Names & identifiers
- Preferred name
- 2-Amino-1,2,3,4-tetrahydronaphthalene-1,6,7-triol
- IUPAC
- 2-amino-1,2,3,4-tetrahydronaphthalene-1,6,7-triol
Names & synonyms
2-Amino-1,2,3,4-tetrahydronaphthalene-1,6,7-triol46269-17-4DTXSID40706594
Database identifiers
- CAS
46269-17-4- PubChem CID
- 53778261
- DTXSID
DTXSID40706594
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 86.7 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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